Cantitate/Preț
Produs

3D QSAR in Drug Design: Ligand-Protein Interactions and Molecular Similarity: Three-Dimensional Quantitative Structure Activity Relationships, cartea 2

Editat de Hugo Kubinyi, Gerd Folkers, Yvonne C. Martin
en Limba Engleză Paperback – 7 dec 2010
Significant progress has been made in the study of three-dimensional quantitative structure-activity relationships (3D QSAR) since the first publication by Richard Cramer in 1988 and the first volume in the series. 3D QSAR in Drug Design. Theory, Methods and Applications, published in 1993. The aim of that early book was to contribute to the understanding and the further application of CoMFA and related approaches and to facilitate the appropriate use of these methods. Since then, hundreds of papers have appeared using the quickly developing techniques of both 3D QSAR and computational sciences to study a broad variety of biological problems. Again the editor(s) felt that the time had come to solicit reviews on published and new viewpoints to document the state of the art of 3D QSAR in its broadest definition and to provide visions of where new techniques will emerge or new appli- tions may be found. The intention is not only to highlight new ideas but also to show the shortcomings, inaccuracies, and abuses of the methods. We hope this book will enable others to separate trivial from visionary approaches and me-too methodology from in- vative techniques. These concerns guided our choice of contributors. To our delight, our call for papers elicited a great many manuscripts.
Citește tot Restrânge

Toate formatele și edițiile

Toate formatele și edițiile Preț Express
Paperback (2) 104230 lei  39-44 zile
  SPRINGER NETHERLANDS – 4 dec 2010 104230 lei  39-44 zile
  SPRINGER NETHERLANDS – 7 dec 2010 107276 lei  39-44 zile
Hardback (2) 105474 lei  39-44 zile
  SPRINGER NETHERLANDS – 30 apr 1998 105474 lei  39-44 zile
  SPRINGER NETHERLANDS – 30 apr 1998 117960 lei  6-8 săpt.

Preț: 107276 lei

Preț vechi: 141154 lei
-24% Nou

Puncte Express: 1609

Preț estimativ în valută:
20531 21659$ 17110£

Carte tipărită la comandă

Livrare economică 30 decembrie 24 - 04 ianuarie 25

Preluare comenzi: 021 569.72.76

Specificații

ISBN-13: 9789048149346
ISBN-10: 9048149347
Pagini: 428
Ilustrații: IX, 417 p.
Dimensiuni: 210 x 297 x 22 mm
Ediția:Softcover reprint of the original 1st ed. 1998
Editura: SPRINGER NETHERLANDS
Colecția Springer
Seria Three-Dimensional Quantitative Structure Activity Relationships

Locul publicării:Dordrecht, Netherlands

Public țintă

Research

Cuprins

Ligand-Protein Interactions.- Progress in Force-Field Calculations of Molecular Interaction Fields and Intermolecular Interactions.- Comparative Binding Energy Analysis.- Receptor-Based Prediction of Binding Affinities.- A Priori Prediction of Ligand Affinity by Energy Minimization.- Rapid Estimation of Relative Binding Affinities of Enzyme Inhibitors.- Binding Affinities and Non-Bonded Interaction Energies.- Molecular Mechanics Calculations on Protein-Ligand Complexes.- Quantum Chemical Models and Molecular Dynamics Simulations.- Some Biological Applications of Semiempirical MO Theory.- Density-Functional Theory and Molecular Dynamics: A New Perspective for Simulations of Biological Systems.- Density-Functional Theory Investigations of Enzyme-substrate Interactions.- Molecular Dynamics Simulations: A Tool for Drug Design.- Pharmacophore Modelling and Molecular Similarity.- Bioisosterism and Molecular Diversity.- Similarity and Dissimilarity: A Medicinal Chemist’s View.- Pharmacophore Modelling: Methods,Experimental Verification and Applications.- The Use of Self-organizing Neural Networks in Drug Design.- Calculation of Structural Similarity by the Alignment of Molecular Electrostatic Potentials.- Explicit Calculation of 3D Molecular Similarity.- Novel Software Tools for Chemical Diversity.- New 3D Molecular Descriptors: The WHIM theory and QSAR Applications.- EVA: A Novel Theoretical Descriptor for QSAR Studies.

Recenzii

`... Volume 3 is a valuable resource text for scientists with a background or serious interest in 3D QSAR who are interested in CoMFA and related methodology. overall this 3 book series is a wonderful reference source for scientists interested 3D QSAR.'
SIM News, 49:4 (1999)